REMARK  Name = BDB014355
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.391  -0.591   0.895  0.00  0.00    +0.169 A 
ATOM      2  C   LIG    1       -1.731  -0.477  -0.315  0.00  0.00    +0.026 A 
ATOM      3  C   LIG    1       -2.298  -0.603  -1.679  0.00  0.00    +0.050 C 
ATOM      4  C   LIG    1       -0.379  -0.192   0.052  0.00  0.00    +0.171 A 
ATOM      5  N   LIG    1       -0.241  -0.190   1.391  0.00  0.00    -0.073 NA
ATOM      6  O   LIG    1       -1.490  -0.449   1.905  0.00  0.00    -0.356 OA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1       -5.715  -0.002   2.744  0.00  0.00    +0.123 C 
ATOM      8  C   LIG    1       -4.198  -0.141   2.592  0.00  0.00    +0.071 C 
ATOM      9  C   LIG    1       -3.797  -0.873   1.312  0.00  0.00    +0.190 C 
ATOM     10  O   LIG    1       -4.663  -0.456   0.259  0.00  0.00    -0.365 OA
ATOM     11  C   LIG    1       -5.974  -1.026   0.379  0.00  0.00    +0.127 C 
ATOM     12  C   LIG    1       -6.496  -0.953   1.832  0.00  0.00    +0.063 C 
BRANCH  11  13
ATOM     13  C   LIG    1       -6.905  -0.423  -0.723  0.00  0.00    -0.011 C 
ATOM     14  C   LIG    1       -6.231  -0.576  -2.105  0.00  0.00    +0.013 C 
ATOM     15  C   LIG    1       -7.173   1.074  -0.497  0.00  0.00    +0.013 C 
ATOM     16  C   LIG    1       -8.251  -1.173  -0.773  0.00  0.00    +0.013 C 
ENDBRANCH  11  13
BRANCH   7  18
ATOM     17  C   LIG    1       -7.192   1.813   3.211  0.00  0.00    +0.194 C 
ATOM     18  O   LIG    1       -6.064   1.360   2.474  0.00  0.00    -0.380 OA
ENDBRANCH   7  18
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1        0.779   0.078  -0.820  0.00  0.00    +0.270 C 
ATOM     20  N   LIG    1        1.941   0.288  -0.097  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1        1.778   0.341   0.906  0.00  0.00    +0.155 HD
ATOM     22  O   LIG    1        0.665   0.140  -2.038  0.00  0.00    -0.268 OA
BRANCH  20  23
ATOM     23  C   LIG    1        3.218   0.561  -0.521  0.00  0.00    +0.047 C 
ATOM     24  C   LIG    1        4.226   1.095   0.471  0.00  0.00    +0.119 C 
ATOM     25  C   LIG    1        3.865   2.503   0.950  0.00  0.00    +0.032 C 
ATOM     26  N   LIG    1        5.513   1.176  -0.278  0.00  0.00    -0.216 NA
ATOM     27  N   LIG    1        5.171   0.850  -1.641  0.00  0.00    -0.269 N 
ATOM     28  C   LIG    1        5.735   1.710  -2.687  0.00  0.00    +0.150 C 
ATOM     29  C   LIG    1        3.826   0.446  -1.712  0.00  0.00    +0.037 C 
ATOM     30  C   LIG    1        3.304  -0.120  -2.992  0.00  0.00    +0.063 C 
BRANCH  26  31
ATOM     31  C   LIG    1        6.529   0.230   0.253  0.00  0.00    +0.077 C 
ATOM     32  C   LIG    1        6.172  -1.277   0.192  0.00  0.00    +0.020 C 
ATOM     33  C   LIG    1        7.389  -2.200   0.329  0.00  0.00    +0.002 C 
ATOM     34  C   LIG    1        8.534  -1.544   1.085  0.00  0.00    +0.000 C 
ATOM     35  C   LIG    1        9.019  -0.275   0.384  0.00  0.00    +0.002 C 
ATOM     36  C   LIG    1        7.914   0.476  -0.368  0.00  0.00    +0.020 C 
ENDBRANCH  26  31
ENDBRANCH  20  23
ENDBRANCH   4  19
TORSDOF 6